==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING/METAL BINDING PROTEIN 09-JUL-12 3VUX . COMPND 2 MOLECULE: POLYUBIQUITIN-C; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.NISHIMASU,R.ISHITANI,O.NUREKI . 326 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17649.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 207 63.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 3.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 16.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 21 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 16.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 0 0 1 2 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 6 3 0 3 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 56 0, 0.0 16,-3.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 127.5 2.3 20.9 1.7 2 2 A Q E -A 16 0A 70 14,-0.2 62,-3.7 12,-0.0 63,-0.4 -0.862 360.0-177.3-109.7 142.7 -0.1 21.9 4.4 3 3 A I E -A 15 0A 0 12,-1.9 12,-2.3 -2,-0.4 2,-0.4 -0.855 20.0-128.2-124.7 171.2 0.4 22.1 8.1 4 4 A F E -Ab 14 66A 22 61,-2.5 63,-3.4 -2,-0.3 2,-0.5 -0.951 11.8-162.3-122.5 140.3 -2.0 23.0 10.9 5 5 A V E -Ab 13 67A 0 8,-2.6 8,-3.3 -2,-0.4 2,-0.5 -0.984 11.0-150.3-121.5 122.3 -1.6 25.5 13.7 6 6 A K E -Ab 12 68A 77 61,-3.4 63,-3.3 -2,-0.5 6,-0.2 -0.799 15.4-156.5 -97.5 131.4 -3.7 25.3 16.8 7 7 A T > - 0 0 13 4,-2.4 3,-2.0 -2,-0.5 63,-0.1 -0.396 34.8 -93.2-101.0 177.1 -4.6 28.5 18.6 8 8 A L T 3 S+ 0 0 11 1,-0.3 319,-0.1 61,-0.2 -1,-0.1 0.721 124.6 55.3 -63.3 -23.2 -5.6 29.4 22.1 9 9 A T T 3 S- 0 0 60 2,-0.1 -1,-0.3 296,-0.1 3,-0.1 0.407 119.6-108.6 -89.1 1.5 -9.3 29.2 21.1 10 10 A G S < S+ 0 0 35 -3,-2.0 -2,-0.1 1,-0.3 2,-0.1 0.424 72.9 144.5 86.5 -1.8 -8.9 25.6 19.8 11 11 A K - 0 0 103 -5,-0.1 -4,-2.4 1,-0.1 2,-0.6 -0.421 45.5-135.5 -70.2 142.0 -9.2 26.9 16.2 12 12 A T E -A 6 0A 75 -6,-0.2 2,-0.5 -2,-0.1 -6,-0.2 -0.905 12.6-156.4-104.3 124.1 -7.1 25.2 13.6 13 13 A I E -A 5 0A 5 -8,-3.3 -8,-2.6 -2,-0.6 2,-0.6 -0.834 7.1-149.0 -94.9 132.1 -5.3 27.3 11.1 14 14 A T E -A 4 0A 56 -2,-0.5 2,-0.4 -10,-0.2 -10,-0.2 -0.902 16.2-169.6-103.1 123.0 -4.3 25.7 7.8 15 15 A L E -A 3 0A 0 -12,-2.3 -12,-1.9 -2,-0.6 2,-0.7 -0.933 21.1-140.4-116.6 132.8 -1.2 27.0 6.2 16 16 A E E +A 2 0A 113 -2,-0.4 2,-0.3 -14,-0.2 -14,-0.2 -0.808 47.4 150.7 -84.1 117.3 0.2 26.3 2.7 17 17 A V - 0 0 7 -16,-3.2 -2,-0.0 -2,-0.7 9,-0.0 -0.848 41.8-125.3-142.2 174.1 4.0 25.9 3.2 18 18 A E > - 0 0 116 -2,-0.3 3,-1.8 4,-0.1 38,-0.3 -0.882 31.7-114.7-120.9 156.3 7.2 24.3 2.0 19 19 A P T 3 S+ 0 0 54 0, 0.0 38,-1.9 0, 0.0 37,-0.4 0.784 118.0 53.8 -60.8 -26.0 9.7 22.2 4.1 20 20 A S T 3 S+ 0 0 89 36,-0.2 2,-0.1 35,-0.2 -3,-0.0 0.455 81.4 118.8 -89.3 -2.5 12.3 25.0 3.6 21 21 A D < - 0 0 27 -3,-1.8 35,-1.7 1,-0.1 36,-0.2 -0.375 62.2-128.0 -62.7 140.3 10.0 27.7 5.0 22 22 A T B > -E 55 0B 35 33,-0.2 4,-1.7 1,-0.1 33,-0.2 -0.394 16.9-113.0 -87.5 167.7 11.3 29.4 8.1 23 23 A I H > S+ 0 0 0 31,-1.7 4,-2.3 29,-0.6 5,-0.2 0.911 119.9 54.9 -65.1 -41.7 9.6 29.9 11.4 24 24 A E H > S+ 0 0 121 28,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.888 107.4 51.5 -57.3 -40.0 9.5 33.6 10.8 25 25 A N H > S+ 0 0 68 27,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.889 108.3 50.7 -61.4 -40.5 7.8 32.9 7.5 26 26 A V H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.876 110.0 49.4 -70.0 -35.0 5.2 30.8 9.2 27 27 A K H X S+ 0 0 14 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.834 108.2 53.7 -72.4 -32.9 4.5 33.5 11.7 28 28 A A H X S+ 0 0 35 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.847 107.6 51.6 -66.9 -35.4 4.1 36.0 8.9 29 29 A K H X S+ 0 0 65 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.896 109.3 50.2 -65.1 -40.8 1.6 33.7 7.3 30 30 A I H X>S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.2 5,-0.6 0.903 107.1 53.8 -65.6 -39.6 -0.3 33.6 10.7 31 31 A Q H X5S+ 0 0 79 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.896 108.5 50.8 -60.2 -39.3 -0.2 37.4 10.8 32 32 A D H <5S+ 0 0 134 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.909 117.5 38.0 -62.7 -44.6 -1.8 37.4 7.4 33 33 A K H <5S+ 0 0 109 -4,-2.0 -2,-0.2 1,-0.1 -1,-0.2 0.839 135.6 17.1 -74.9 -36.1 -4.6 35.0 8.3 34 34 A E H <5S- 0 0 46 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.589 93.0-120.3-119.0 -20.6 -5.3 36.2 11.9 35 35 A G << + 0 0 42 -4,-2.0 -4,-0.2 -5,-0.6 -3,-0.1 0.634 60.1 145.2 84.8 16.1 -3.8 39.7 12.2 36 36 A I - 0 0 6 -6,-0.5 -1,-0.2 -9,-0.1 -2,-0.1 -0.785 53.5-119.1 -95.4 121.1 -1.4 38.8 15.1 37 37 A P > - 0 0 37 0, 0.0 3,-2.0 0, 0.0 4,-0.2 -0.325 21.3-128.9 -55.1 132.6 2.0 40.5 15.2 38 38 A P G > S+ 0 0 39 0, 0.0 3,-1.1 0, 0.0 -10,-0.1 0.703 104.9 65.9 -59.5 -24.2 4.8 37.9 14.9 39 39 A D G 3 S+ 0 0 81 1,-0.2 33,-0.0 3,-0.0 -3,-0.0 0.594 101.6 50.5 -76.2 -7.0 6.6 39.2 17.9 40 40 A Q G < S+ 0 0 32 -3,-2.0 32,-2.1 31,-0.1 2,-0.4 0.410 94.7 95.8-103.9 -1.4 3.6 38.1 20.0 41 41 A Q E < -C 71 0A 0 -3,-1.1 2,-0.5 -4,-0.2 30,-0.2 -0.754 48.0-175.9 -95.6 133.4 3.6 34.6 18.5 42 42 A R E -C 70 0A 45 28,-2.4 28,-3.1 -2,-0.4 2,-0.4 -0.966 13.8-156.8-124.0 113.9 5.3 31.6 20.1 43 43 A L E -C 69 0A 0 -2,-0.5 7,-2.4 7,-0.4 2,-0.4 -0.760 8.2-167.8 -93.7 137.2 5.1 28.4 18.0 44 44 A I E +CD 68 49A 25 24,-2.8 24,-3.2 -2,-0.4 2,-0.4 -0.981 9.7 177.5-126.4 130.0 5.4 25.0 19.6 45 45 A F E > S- D 0 48A 32 3,-2.3 3,-2.1 -2,-0.4 22,-0.1 -0.998 77.5 -7.5-132.0 132.1 6.0 21.6 18.0 46 46 A A T 3 S- 0 0 79 -2,-0.4 -1,-0.1 20,-0.3 3,-0.1 0.834 128.8 -60.2 51.5 34.8 6.4 18.4 20.0 47 47 A G T 3 S+ 0 0 72 1,-0.2 2,-0.4 21,-0.0 -1,-0.3 0.477 114.0 116.5 78.2 2.2 6.5 20.6 23.1 48 48 A K E < -D 45 0A 82 -3,-2.1 -3,-2.3 1,-0.0 -1,-0.2 -0.883 67.8-120.1-111.1 133.9 9.6 22.5 21.9 49 49 A Q E -D 44 0A 120 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.488 30.3-129.0 -72.5 137.3 9.6 26.2 21.2 50 50 A L - 0 0 5 -7,-2.4 -7,-0.4 -2,-0.2 2,-0.3 -0.747 11.8-132.3-100.7 132.4 10.6 27.0 17.6 51 51 A E > - 0 0 112 -2,-0.4 3,-1.7 1,-0.1 -28,-0.5 -0.600 15.8-127.4 -86.2 137.4 13.3 29.5 16.6 52 52 A D T 3 S+ 0 0 82 -2,-0.3 -28,-2.1 1,-0.3 -29,-0.6 0.796 103.5 51.4 -49.8 -42.6 12.6 32.2 13.9 53 53 A G T 3 S+ 0 0 69 -30,-0.2 2,-0.3 -31,-0.2 -1,-0.3 0.182 93.7 92.5 -89.8 19.4 15.6 31.4 11.7 54 54 A R S < S- 0 0 88 -3,-1.7 -31,-1.7 1,-0.0 -30,-0.2 -0.777 71.1-118.0-115.3 156.7 15.1 27.7 11.4 55 55 A T B -E 22 0B 33 -2,-0.3 4,-0.4 -33,-0.2 -33,-0.2 -0.462 22.2-117.6 -89.7 163.0 13.2 25.6 8.8 56 56 A L S > >S+ 0 0 0 -35,-1.7 5,-1.8 -37,-0.4 3,-1.6 0.900 117.7 55.9 -60.5 -39.6 10.2 23.4 9.3 57 57 A S G > 5S+ 0 0 73 -38,-1.9 3,-2.7 1,-0.3 -1,-0.2 0.869 94.3 66.0 -63.9 -36.9 12.3 20.5 8.2 58 58 A D G 3 5S+ 0 0 85 1,-0.3 -1,-0.3 -39,-0.3 -2,-0.2 0.711 108.1 42.2 -56.1 -20.2 14.9 21.3 10.9 59 59 A Y G < 5S- 0 0 14 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.227 116.3-115.1-110.6 13.0 12.1 20.3 13.3 60 60 A N T < 5 + 0 0 103 -3,-2.7 2,-0.6 1,-0.2 -3,-0.2 0.900 54.7 166.3 50.4 44.5 10.9 17.3 11.4 61 61 A I < - 0 0 6 -5,-1.8 -1,-0.2 -42,-0.1 2,-0.1 -0.824 15.8-172.0 -89.2 124.1 7.6 19.0 10.7 62 62 A Q > - 0 0 68 -2,-0.6 3,-2.1 1,-0.2 2,-0.1 -0.442 33.9 -52.5-116.4-179.1 5.8 17.0 8.0 63 63 A K T 3 S+ 0 0 54 1,-0.3 -60,-0.2 -2,-0.1 -1,-0.2 -0.381 125.9 2.3 -59.1 124.4 2.8 17.1 5.7 64 64 A E T 3 S+ 0 0 26 -62,-3.7 -1,-0.3 1,-0.2 2,-0.2 0.773 91.9 151.3 64.4 30.0 -0.3 17.7 7.9 65 65 A S < - 0 0 5 -3,-2.1 -61,-2.5 -63,-0.4 2,-0.5 -0.588 40.6-128.8 -79.5 155.6 1.7 17.9 11.1 66 66 A T E -b 4 0A 37 215,-0.4 -20,-0.3 -2,-0.2 2,-0.2 -0.936 21.3-169.0-116.7 129.5 0.1 20.1 13.8 67 67 A L E -b 5 0A 0 -63,-3.4 -61,-3.4 -2,-0.5 2,-0.4 -0.712 17.8-128.9-107.4 160.0 1.8 23.0 15.7 68 68 A H E -bC 6 44A 59 -24,-3.2 -24,-2.8 -2,-0.2 2,-0.6 -0.940 14.7-150.2-112.8 133.5 0.6 24.9 18.8 69 69 A L E - C 0 43A 3 -63,-3.3 2,-0.4 -2,-0.4 -26,-0.2 -0.894 12.3-174.9-105.9 119.6 0.5 28.7 18.9 70 70 A V E - C 0 42A 10 -28,-3.1 -28,-2.4 -2,-0.6 2,-0.5 -0.916 15.3-143.0-110.4 138.0 0.9 30.5 22.2 71 71 A L E + C 0 41A 6 -2,-0.4 2,-0.4 -30,-0.2 -30,-0.2 -0.874 21.2 174.8-105.7 131.5 0.5 34.3 22.4 72 72 A R - 0 0 33 -32,-2.1 2,-0.1 -2,-0.5 -2,-0.0 -0.994 26.6-126.1-135.3 138.7 2.7 36.5 24.7 73 73 A L - 0 0 71 -2,-0.4 2,-0.4 2,-0.0 249,-0.0 -0.373 22.5-138.7 -72.9 161.3 2.9 40.3 25.1 74 74 A R + 0 0 149 1,-0.1 -34,-0.0 -2,-0.1 -35,-0.0 -0.986 25.3 171.8-128.2 125.1 6.3 42.0 24.8 75 75 A G 0 0 88 -2,-0.4 -1,-0.1 0, 0.0 -2,-0.0 0.566 360.0 360.0-104.7 -13.3 7.4 44.7 27.1 76 76 A G 0 0 119 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.832 360.0 360.0 64.5 360.0 11.0 45.1 26.1 77 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 78 1 B M 0 0 63 0, 0.0 16,-2.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 155.5 -21.9 6.3 3.3 79 2 B Q E -F 93 0C 70 14,-0.2 62,-4.1 12,-0.0 63,-0.4 -0.851 360.0-177.0-103.7 138.7 -20.9 9.0 0.8 80 3 B I E -F 92 0C 0 12,-1.6 12,-2.5 -2,-0.4 2,-0.4 -0.923 20.1-132.1-124.4 160.3 -21.4 8.8 -2.9 81 4 B F E -Fg 91 143C 47 61,-3.2 63,-3.1 -2,-0.3 2,-0.6 -0.915 9.9-157.1-114.8 136.9 -20.3 11.3 -5.4 82 5 B V E -Fg 90 144C 0 8,-3.0 8,-2.4 -2,-0.4 2,-0.4 -0.938 8.3-153.2-117.9 111.1 -22.5 12.8 -8.2 83 6 B K E -Fg 89 145C 84 61,-3.3 63,-3.1 -2,-0.6 6,-0.2 -0.694 21.7-155.9 -84.9 126.2 -20.7 14.2 -11.2 84 7 B T > - 0 0 14 4,-3.2 3,-1.7 -2,-0.4 63,-0.1 -0.226 32.0 -81.3-101.5-175.1 -22.7 16.9 -12.9 85 8 B L T 3 S+ 0 0 13 1,-0.3 156,-0.1 153,-0.1 175,-0.1 0.857 127.3 41.9 -49.5 -45.3 -23.1 18.6 -16.3 86 9 B T T 3 S- 0 0 60 152,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.375 122.0 -99.4 -91.9 4.9 -20.1 20.9 -15.8 87 10 B G S < S+ 0 0 39 -3,-1.7 -2,-0.1 1,-0.3 -1,-0.0 0.313 77.2 145.0 92.3 -8.7 -17.8 18.3 -14.3 88 11 B K - 0 0 96 -5,-0.1 -4,-3.2 1,-0.1 2,-0.5 -0.334 40.8-143.3 -58.8 140.2 -18.6 19.5 -10.8 89 12 B T E -F 83 0C 73 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.949 13.2-165.7-113.9 126.0 -18.7 16.8 -8.2 90 13 B I E -F 82 0C 12 -8,-2.4 -8,-3.0 -2,-0.5 2,-0.4 -0.848 13.0-137.5-108.0 149.6 -21.2 16.9 -5.3 91 14 B T E -F 81 0C 54 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.874 19.1-167.4-106.3 134.5 -21.1 14.7 -2.2 92 15 B L E -F 80 0C 2 -12,-2.5 -12,-1.6 -2,-0.4 2,-0.7 -0.950 19.7-137.5-123.0 144.1 -24.2 13.1 -0.8 93 16 B E E +F 79 0C 122 -2,-0.4 2,-0.2 -14,-0.2 -14,-0.2 -0.887 45.7 156.3 -97.9 113.3 -24.8 11.4 2.5 94 17 B V - 0 0 4 -16,-2.7 3,-0.0 -2,-0.7 -2,-0.0 -0.738 39.0-134.0-132.3 173.5 -26.9 8.3 1.7 95 18 B E > - 0 0 111 -2,-0.2 3,-1.7 4,-0.1 38,-0.3 -0.925 31.1-119.0-122.6 154.9 -27.9 4.8 2.8 96 19 B P T 3 S+ 0 0 55 0, 0.0 38,-2.6 0, 0.0 37,-0.6 0.810 117.2 58.8 -58.3 -28.5 -28.1 1.7 0.6 97 20 B S T 3 S+ 0 0 90 36,-0.2 2,-0.2 35,-0.2 -3,-0.0 0.464 81.3 112.5 -80.7 -3.2 -31.8 1.6 1.4 98 21 B D < - 0 0 26 -3,-1.7 35,-1.7 1,-0.1 36,-0.2 -0.532 66.4-130.8 -70.7 134.3 -32.2 5.1 -0.1 99 22 B T B > -J 132 0D 30 -2,-0.2 4,-2.1 33,-0.2 3,-0.3 -0.432 20.3-114.0 -78.4 159.4 -34.2 5.1 -3.3 100 23 B I H > S+ 0 0 0 31,-2.5 4,-2.5 28,-0.6 29,-0.2 0.882 122.4 59.6 -56.2 -37.4 -33.1 6.9 -6.4 101 24 B E H > S+ 0 0 119 28,-2.1 4,-1.4 30,-0.3 -1,-0.2 0.862 104.1 49.4 -58.7 -38.0 -36.0 9.1 -5.8 102 25 B N H > S+ 0 0 65 -3,-0.3 4,-1.9 27,-0.3 -1,-0.2 0.920 108.7 52.5 -65.9 -43.5 -34.5 10.0 -2.4 103 26 B V H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.897 106.6 52.0 -62.0 -41.7 -31.1 10.8 -4.0 104 27 B K H X S+ 0 0 9 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.876 107.3 53.3 -63.5 -36.4 -32.7 13.2 -6.5 105 28 B A H X S+ 0 0 38 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.867 107.6 51.9 -62.8 -37.7 -34.4 14.9 -3.6 106 29 B K H X S+ 0 0 67 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.889 109.9 48.5 -63.5 -40.7 -30.9 15.2 -2.0 107 30 B I H X>S+ 0 0 0 -4,-2.2 4,-3.8 2,-0.2 5,-0.7 0.900 108.1 54.6 -67.3 -39.1 -29.6 16.7 -5.3 108 31 B Q H X5S+ 0 0 82 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.885 109.3 48.3 -61.0 -38.7 -32.6 19.1 -5.3 109 32 B D H <5S+ 0 0 136 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.937 118.9 39.7 -63.2 -48.1 -31.6 20.3 -1.8 110 33 B K H <5S+ 0 0 129 -4,-2.4 -2,-0.2 1,-0.1 -3,-0.2 0.939 135.3 14.1 -67.9 -49.1 -28.0 20.7 -2.8 111 34 B E H <5S- 0 0 60 -4,-3.8 -3,-0.2 2,-0.2 -2,-0.2 0.614 91.5-121.5-111.6 -16.9 -28.4 22.2 -6.3 112 35 B G << + 0 0 40 -4,-1.4 -4,-0.2 -5,-0.7 -3,-0.1 0.461 61.7 141.4 90.2 1.0 -32.0 23.3 -6.7 113 36 B I - 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0 0 19 -11,-2.6 -11,-0.4 -2,-0.4 2,-0.3 -0.468 13.2-152.8 -88.0 164.7 -5.6 29.6 34.7 313 772 G N > - 0 0 47 6,-2.1 5,-2.9 -2,-0.1 3,-0.5 -0.940 23.4-120.0-135.3 163.3 -8.2 31.3 36.8 314 773 G A T > 5S+ 0 0 94 -2,-0.3 3,-1.7 1,-0.2 5,-0.1 0.815 109.1 60.6 -73.1 -31.9 -12.0 31.1 37.1 315 774 G K T 3 5S+ 0 0 188 1,-0.3 -1,-0.2 2,-0.1 -3,-0.0 0.755 110.2 44.8 -66.7 -23.3 -12.7 34.8 36.3 316 775 G C T > 5S- 0 0 8 -3,-0.5 3,-1.3 3,-0.3 -1,-0.3 0.159 120.8-109.7-105.1 16.8 -11.0 34.1 33.0 317 776 G N T < 5S- 0 0 111 -3,-1.7 -3,-0.2 1,-0.3 -2,-0.1 0.649 80.7 -43.8 66.0 19.5 -12.9 30.8 32.4 318 777 G G T 3 - 0 0 6 -8,-0.3 4,-2.0 -2,-0.2 -8,-0.1 -0.390 36.7-103.2 -77.7 170.3 -4.6 32.8 32.4 321 780 G N H > S+ 0 0 111 -10,-0.3 4,-2.1 2,-0.2 5,-0.1 0.896 120.0 53.5 -60.6 -41.6 -5.0 36.6 32.4 322 781 G E H > S+ 0 0 47 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.932 111.8 42.3 -65.1 -47.2 -2.6 37.0 29.5 323 782 G C H > S+ 0 0 1 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.857 111.6 57.0 -67.9 -31.2 -4.3 34.5 27.2 324 783 G F H X S+ 0 0 42 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.880 105.7 50.5 -68.0 -35.9 -7.7 35.9 28.2 325 784 G Q H X S+ 0 0 99 -4,-2.1 4,-1.0 2,-0.2 3,-0.3 0.974 112.9 45.1 -60.9 -56.0 -6.5 39.4 27.1 326 785 G F H >X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 3,-0.6 0.866 111.2 54.8 -54.0 -40.9 -5.4 38.0 23.7 327 786 G K H 3X S+ 0 0 62 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.878 102.6 54.9 -63.6 -38.5 -8.6 36.0 23.4 328 787 G Q H 3< S+ 0 0 118 -4,-2.0 -1,-0.2 -3,-0.3 -2,-0.2 0.748 116.4 41.5 -65.0 -21.9 -10.7 39.2 23.9 329 788 G M H << S+ 0 0 103 -4,-1.0 -2,-0.2 -3,-0.6 -1,-0.2 0.924 131.2 15.5 -87.4 -55.4 -8.8 40.6 21.0 330 789 G Y H < 0 0 71 -4,-2.9 -3,-0.2 -5,-0.1 -2,-0.2 0.479 360.0 360.0-108.4 -7.6 -8.5 37.8 18.4 331 790 G G < 0 0 92 -4,-1.9 -4,-0.0 -5,-0.4 -323,-0.0 -0.354 360.0 360.0 -75.5 360.0 -11.1 35.2 19.5